Geometry & MOs

Info

ID:	35097
PubChem CID:	7979301
Reduced:	N2O3C20H32 (1)
Stoich.:	A2B3C20D32 (1)
Weight, g/mol:	349.109627
ΔH_f, kcal/mol:	-124.37
Dipole, Da:	2.99
IP(EA), eV:	-8.36(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[3-[(3aS,7aR)-1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl]propanoyl]thiophene-2-carbohydrazide

Drug info:

PubChemData

Smile

CN(C)[C@@H](CNC(=O)CC1CCCCC1)C2=CC(=C(C=C2)OC)OC

DOS

IR

Vibrations